SCHEMBL28095156

SCHEMBL28095156

CCNC(=O)OCCOC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
TSHR P16473 1/20 0.52
ACHE P22303 8/20 0.52
CHRNB2 P17787 2/20 0.52
CHRNB4 P30926 2/20 0.52
CHRNA3 P32297 2/20 0.52
CHRNA4 P43681 2/20 0.52
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
LMNA P02545 1/20 0.44
HSD17B10 Q99714 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
PGR P06401 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
HTR1A P08908 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
TBXA2R P21731 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16674069 0.91 ACHE (0.60) ALDH1A1ACHECHRNB2CHRNB4CHRNA3
SCHEMBL11378769 0.83 ACHE (0.64) ALDH1A1TSHRACHECHRNB2CHRNB4
SCHEMBL23834421 0.82 EPHX1 (0.55) ALDH1A1ACHECHRNB2CHRNB4CHRNA3
SCHEMBL10050100 0.82 ACHE (0.52) ALDH1A1TSHRACHECHRNB2CHRNB4
SCHEMBL965762 0.81
SCHEMBL16673943 0.81 ACHE (0.63) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL5174474 0.80 ALDH1A1 (0.56) ALDH1A1TSHRACHECHRNB2CHRNB4
SCHEMBL890339 0.79 THRB (0.58) ALDH1A1TSHRACHECHRNB2CHRNB4
SCHEMBL5249543 0.79
SCHEMBL10812054 0.79 ACHE (0.67) ACHECHRNB2CHRNB4CHRNA3CHRNA4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106249542-A Semiconductor device, stack-up type semiconductor device, sealing back-set bed type semiconductor device and the manufacture method of these devices 信越化学工业株式会社 2016-12-21 CN disclosed